N-[5-[(2-chlorophenyl)methyl]-1,3-thiazol-2-yl]-2-(8-methylimidazo[1,2-a]pyridin-2-yl)acetamide

C20H17ClN4OS — CID 86877063

About N-[5-[(2-chlorophenyl)methyl]-1,3-thiazol-2-yl]-2-(8-methylimidazo[1,2-a]pyridin-2-yl)acetamide

N-[5-[(2-chlorophenyl)methyl]-1,3-thiazol-2-yl]-2-(8-methylimidazo[1,2-a]pyridin-2-yl)acetamide (PubChem CID 86877063) has the molecular formula C20H17ClN4OS and a molecular weight of 396.90 g/mol. Its IUPAC name is N-[5-[(2-chlorophenyl)methyl]-1,3-thiazol-2-yl]-2-(8-methylimidazo[1,2-a]pyridin-2-yl)acetamide.

Molecular Properties

• Compound Name: N-[5-[(2-chlorophenyl)methyl]-1,3-thiazol-2-yl]-2-(8-methylimidazo[1,2-a]pyridin-2-yl)acetamide
• PubChem CID: 86877063
• Molecular Formula: C20H17ClN4OS
• Molecular Weight: 396.90 g/mol
• Exact Mass: 396.08
• IUPAC Name: N-[5-[(2-chlorophenyl)methyl]-1,3-thiazol-2-yl]-2-(8-methylimidazo[1,2-a]pyridin-2-yl)acetamide
• SMILES: Cc1cccn2cc(CC(=O)Nc3ncc(Cc4ccccc4Cl)s3)nc12
• InChI: InChI=1S/C20H17ClN4OS/c1-13-5-4-8-25-12-15(23-19(13)25)10-18(26)24-20-22-11-16(27-20)9-14-6-2-3-7-17(14)21/h2-8,11-12H,9-10H2,1H3,(H,22,24,26)
• InChIKey: IXJJPYDHKYRLMY-UHFFFAOYSA-N
• XLogP: 4.52
• TPSA: 59.29 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 5
• Rotatable Bonds: 5
• Heavy Atoms: 27
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	396.90
LogP ≤ 5	4.52
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

What is the IUPAC name of N-[5-[(2-chlorophenyl)methyl]-1,3-thiazol-2-yl]-2-(8-methylimidazo[1,2-a]pyridin-2-yl)acetamide?

The IUPAC name of N-[5-[(2-chlorophenyl)methyl]-1,3-thiazol-2-yl]-2-(8-methylimidazo[1,2-a]pyridin-2-yl)acetamide (CID 86877063) is N-[5-[(2-chlorophenyl)methyl]-1,3-thiazol-2-yl]-2-(8-methylimidazo[1,2-a]pyridin-2-yl)acetamide.

What is the SMILES notation for N-[5-[(2-chlorophenyl)methyl]-1,3-thiazol-2-yl]-2-(8-methylimidazo[1,2-a]pyridin-2-yl)acetamide?

The canonical SMILES for N-[5-[(2-chlorophenyl)methyl]-1,3-thiazol-2-yl]-2-(8-methylimidazo[1,2-a]pyridin-2-yl)acetamide is Cc1cccn2cc(CC(=O)Nc3ncc(Cc4ccccc4Cl)s3)nc12.

What is the InChIKey of N-[5-[(2-chlorophenyl)methyl]-1,3-thiazol-2-yl]-2-(8-methylimidazo[1,2-a]pyridin-2-yl)acetamide?

The InChIKey is IXJJPYDHKYRLMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17ClN4OS/c1-13-5-4-8-25-12-15(23-19(13)25)10-18(26)24-20-22-11-16(27-20)9-14-6-2-3-7-17(14)21/h2-8,11-12H,9-10H2,1H3,(H,22,24,26).

What are the key properties of N-[5-[(2-chlorophenyl)methyl]-1,3-thiazol-2-yl]-2-(8-methylimidazo[1,2-a]pyridin-2-yl)acetamide?

N-[5-[(2-chlorophenyl)methyl]-1,3-thiazol-2-yl]-2-(8-methylimidazo[1,2-a]pyridin-2-yl)acetamide has a molecular weight of 396.90 g/mol, XLogP of 4.52, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for N-[5-[(2-chlorophenyl)methyl]-1,3-thiazol-2-yl]-2-(8-methylimidazo[1,2-a]pyridin-2-yl)acetamide is sourced from PubChem (CID 86877063), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).